(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone

C95H112Cl2F9N13O10 — CID 157145261

About (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone

(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone (PubChem CID 157145261) has the molecular formula C95H112Cl2F9N13O10 and a molecular weight of 1837.91 g/mol. Its IUPAC name is (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone.

Molecular Properties

• Compound Name: (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone
• PubChem CID: 157145261
• Molecular Formula: C95H112Cl2F9N13O10
• Molecular Weight: 1837.91 g/mol
• Exact Mass: 1835.79
• IUPAC Name: (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone
• SMILES: CC(C)Oc1ccc(C(=O)N2CCC3(CC2)c2ccc(C(=O)C(F)(F)F)n2CCN3C)cc1C(F)(F)F.CC(C)Oc1ccc(C(=O)N2CCC3(CC2)c2ccc(Cl)n2CCN3C)cc1CO.CN1CCn2c(Cl)ccc2C12CCN(C(=O)c1cccc3cccnc13)CC2.COc1cc(C(=O)N2CCC3(CC2)c2ccc(C(F)(F)F)n2C[C@@H](C)N3C)ccc1OC(C)C
• InChI: InChI=1S/C25H27F6N3O3.C25H32F3N3O3.C23H30ClN3O3.C22H23ClN4O/c1-15(2)37-19-6-4-16(14-17(19)24(26,27)28)22(36)33-10-8-23(9-11-33)20-7-5-18(21(35)25(29,30)31)34(20)13-12-32(23)3;1-16(2)34-19-7-6-18(14-20(19)33-5)23(32)30-12-10-24(11-13-30)21-8-9-22(25(26,27)28)31(21)15-17(3)29(24)4;1-16(2)30-19-5-4-17(14-18(19)15-28)22(29)26-10-8-23(9-11-26)20-6-7-21(24)27(20)13-12-25(23)3;1-25-14-15-27-18(7-8-19(27)23)22(25)9-12-26(13-10-22)21(28)17-6-2-4-16-5-3-11-24-20(16)17/h4-7,14-15H,8-13H2,1-3H3;6-9,14,16-17H,10-13,15H2,1-5H3;4-7,14,16,28H,8-13,15H2,1-3H3;2-8,11H,9-10,12-15H2,1H3/t;17-;;/m.1../s1
• InChIKey: AKPZQZMBKZRGGX-QSPMGRJTSA-N
• XLogP: 17.15
• TPSA: 201.03 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 19
• Rotatable Bonds: 13
• Heavy Atoms: 129
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1837.91
LogP ≤ 5	17.15
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone?

The IUPAC name of (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone (CID 157145261) is (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone.

What is the SMILES notation for (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone?

The canonical SMILES for (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone is CC(C)Oc1ccc(C(=O)N2CCC3(CC2)c2ccc(C(=O)C(F)(F)F)n2CCN3C)cc1C(F)(F)F.CC(C)Oc1ccc(C(=O)N2CCC3(CC2)c2ccc(Cl)n2CCN3C)cc1CO.CN1CCn2c(Cl)ccc2C12CCN(C(=O)c1cccc3cccnc13)CC2.COc1cc(C(=O)N2CCC3(CC2)c2ccc(C(F)(F)F)n2C[C@@H](C)N3C)ccc1OC(C)C.

What is the InChIKey of (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone?

The InChIKey is AKPZQZMBKZRGGX-QSPMGRJTSA-N. The full InChI is InChI=1S/C25H27F6N3O3.C25H32F3N3O3.C23H30ClN3O3.C22H23ClN4O/c1-15(2)37-19-6-4-16(14-17(19)24(26,27)28)22(36)33-10-8-23(9-11-33)20-7-5-18(21(35)25(29,30)31)34(20)13-12-32(23)3;1-16(2)34-19-7-6-18(14-20(19)33-5)23(32)30-12-10-24(11-13-30)21-8-9-22(25(26,27)28)31(21)15-17(3)29(24)4;1-16(2)30-19-5-4-17(14-18(19)15-28)22(29)26-10-8-23(9-11-26)20-6-7-21(24)27(20)13-12-25(23)3;1-25-14-15-27-18(7-8-19(27)23)22(25)9-12-26(13-10-22)21(28)17-6-2-4-16-5-3-11-24-20(16)17/h4-7,14-15H,8-13H2,1-3H3;6-9,14,16-17H,10-13,15H2,1-5H3;4-7,14,16,28H,8-13,15H2,1-3H3;2-8,11H,9-10,12-15H2,1H3/t;17-;;/m.1../s1.

What are the key properties of (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone?

(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone has a molecular weight of 1837.91 g/mol, XLogP of 17.15, 13 rotatable bonds, 1 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for (6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-[3-(hydroxymethyl)-4-propan-2-yloxyphenyl]methanone;(6-chloro-2-methylspiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl)-quinolin-8-ylmethanone;[(3R)-2,3-dimethyl-6-(trifluoromethyl)spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-1'-yl]-(3-methoxy-4-propan-2-yloxyphenyl)methanone;2,2,2-trifluoro-1-[2-methyl-1'-[4-propan-2-yloxy-3-(trifluoromethyl)benzoyl]spiro[3,4-dihydropyrrolo[1,2-a]pyrazine-1,4'-piperidine]-6-yl]ethanone is sourced from PubChem (CID 157145261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).